SCHEMBL6827803

SCHEMBL6827803

CS(=O)(=O)c1ccc(Cn2c(C(O)Cc3ccccc3)c(-c3ccccc3)c3cc(Br)ccc3c2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 19/20 0.67
MAPK9 P45984 1/20 0.67
MAPK10 P53779 1/20 0.67
DPP4 P27487 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4712892 0.94 MAPK8 (0.67) MAPK8MAPK9MAPK10DPP4
SCHEMBL4713811 0.92 MAPK8 (0.56) MAPK8MAPK9MAPK10DPP4
SCHEMBL4709264 0.91 MAPK8 (0.68) MAPK8MAPK9MAPK10DPP4
SCHEMBL4713919 0.90 MAPK8 (0.60) MAPK8MAPK9MAPK10DPP4
SCHEMBL4709765 0.88 MAPK8 (0.64) MAPK8MAPK9MAPK10DPP4
SCHEMBL4710998 0.85 MAPK8 (0.82) MAPK8MAPK9MAPK10
SCHEMBL4710478 0.84 MAPK8 (0.70) MAPK8MAPK9MAPK10DPP4
SCHEMBL4711756 0.83 MAPK8 (0.73) MAPK8MAPK9MAPK10DPP4
SCHEMBL4709199 0.83 MAPK8 (0.64) MAPK8MAPK9MAPK10DPP4
SCHEMBL4711062 0.83 MAPK8 (0.81) MAPK8MAPK9MAPK10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1484320-A1 JNK INHIBITOR Takeda Chemical Industries, Ltd. (JP) 2004-12-08 EP disclosed